2-[4-(difluoromethyl)-5-propan-2-yl-1,3-thiazol-2-yl]propan-2-ol

C10H15F2NOS — CID 169162896

IUPAC2-[4-(difluoromethyl)-5-propan-2-yl-1,3-thiazol-2-yl]propan-2-ol
SMILESCC(C)c1sc(C(C)(C)O)nc1C(F)F
InChIInChI=1S/C10H15F2NOS/c1-5(2)7-6(8(11)12)13-9(15-7)10(3,4)14/h5,8,14H,1-4H3
InChIKeyPNCPPLZWPRBMGI-UHFFFAOYSA-N
MW235.30 g/mol
LogP3.43
Rot. Bonds3

About 2-[4-(difluoromethyl)-5-propan-2-yl-1,3-thiazol-2-yl]propan-2-ol

2-[4-(difluoromethyl)-5-propan-2-yl-1,3-thiazol-2-yl]propan-2-ol (PubChem CID 169162896) has the molecular formula C10H15F2NOS and a molecular weight of 235.30 g/mol. Its IUPAC name is 2-[4-(difluoromethyl)-5-propan-2-yl-1,3-thiazol-2-yl]propan-2-ol.

Molecular Properties

Compound Name2-[4-(difluoromethyl)-5-propan-2-yl-1,3-thiazol-2-yl]propan-2-ol
PubChem CID169162896
Molecular FormulaC10H15F2NOS
Molecular Weight235.30 g/mol
Exact Mass235.08
IUPAC Name2-[4-(difluoromethyl)-5-propan-2-yl-1,3-thiazol-2-yl]propan-2-ol
SMILESCC(C)c1sc(C(C)(C)O)nc1C(F)F
InChIInChI=1S/C10H15F2NOS/c1-5(2)7-6(8(11)12)13-9(15-7)10(3,4)14/h5,8,14H,1-4H3
InChIKeyPNCPPLZWPRBMGI-UHFFFAOYSA-N
XLogP3.43
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.30
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(difluoromethyl)-5-propan-2-yl-1,3-thiazol-2-yl]propan-2-ol?
The IUPAC name of 2-[4-(difluoromethyl)-5-propan-2-yl-1,3-thiazol-2-yl]propan-2-ol (CID 169162896) is 2-[4-(difluoromethyl)-5-propan-2-yl-1,3-thiazol-2-yl]propan-2-ol.
What is the SMILES notation for 2-[4-(difluoromethyl)-5-propan-2-yl-1,3-thiazol-2-yl]propan-2-ol?
The canonical SMILES for 2-[4-(difluoromethyl)-5-propan-2-yl-1,3-thiazol-2-yl]propan-2-ol is CC(C)c1sc(C(C)(C)O)nc1C(F)F.
What is the InChIKey of 2-[4-(difluoromethyl)-5-propan-2-yl-1,3-thiazol-2-yl]propan-2-ol?
The InChIKey is PNCPPLZWPRBMGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F2NOS/c1-5(2)7-6(8(11)12)13-9(15-7)10(3,4)14/h5,8,14H,1-4H3.
What are the key properties of 2-[4-(difluoromethyl)-5-propan-2-yl-1,3-thiazol-2-yl]propan-2-ol?
2-[4-(difluoromethyl)-5-propan-2-yl-1,3-thiazol-2-yl]propan-2-ol has a molecular weight of 235.30 g/mol, XLogP of 3.43, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(difluoromethyl)-5-propan-2-yl-1,3-thiazol-2-yl]propan-2-ol is sourced from PubChem (CID 169162896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).